5XT5

SufS-SufU complex from Bacillus subtilis

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SPRING-8 BEAMLINE BL26B1
Synchrotron site	SPring-8
Beamline	BL26B1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-06-08
Detector	DECTRIS EIGER X 4M
Wavelength(s)	1.28229
Spacegroup name	P 65
Unit cell lengths	74.980, 74.980, 364.410
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	64.930 - 2.340
R-factor	0.2007
Rwork	0.199
R-free	0.24260
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5j8q 2azh
RMSD bond length	0.019
RMSD bond angle	2.002
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	MOLREP
Refinement software	REFMAC (5.8.0158)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	64.930	64.930	2.440
High resolution limit [Å]	2.340	10.000	2.340
Rmerge	0.072	0.022	0.979
Rmeas	0.080	0.025	1.079
Total number of observations	509344
Number of reflections	95808	1221	11155
<I/σ(I)>	14.87	48.52	1.74
Completeness [%]	99.2	98.4	98.6
Redundancy	5.316	4.959	5.577
CC(1/2)	0.999	0.999	0.612

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7	293	0.2 M Potassium nitrate, 20 % (w/v) PEG3350